Compound Detail
CHEMBL1091188
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Basic Information
| ChEMBL ID | CHEMBL1091188 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JXXYJZKRHMQLRO-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names
Molecular Properties
455.4
MW (Da)
6.37
ALogP
5
HBA
0
HBD
22.1
PSA (Ų)
0.34
QED
1
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 9.96
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | Ki | 9.96 | 9.585 | 0.1 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | Ki | = | 0.11 | nM | 9.96 | Displacement of [125I]TZDM from amyloid beta (1 to 42) aggregates after 2 hrs | 20211565 |
| Unchecked | Ki | = | 0.61 | nM | 9.21 | Displacement of [125I]TZDM from amyloid beta (1 to 40) aggregates after 2 hrs | 20211565 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 20211565 | 10.1016/j.bmc.2010.02.002 | Unchecked | 3 |
Data from ChEMBL 36 via Core Engine